Literature DB >> 24121860

Coarse-graining DNA for simulations of DNA nanotechnology.

Jonathan P K Doye1, Thomas E Ouldridge, Ard A Louis, Flavio Romano, Petr Šulc, Christian Matek, Benedict E K Snodin, Lorenzo Rovigatti, John S Schreck, Ryan M Harrison, William P J Smith.   

Abstract

To simulate long time and length scale processes involving DNA it is necessary to use a coarse-grained description. Here we provide an overview of different approaches to such coarse-graining, focussing on those at the nucleotide level that allow the self-assembly processes associated with DNA nanotechnology to be studied. OxDNA, our recently-developed coarse-grained DNA model, is particularly suited to this task, and has opened up this field to systematic study by simulations. We illustrate some of the range of DNA nanotechnology systems to which the model is being applied, as well as the insights it can provide into fundamental biophysical properties of DNA.

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Year:  2013        PMID: 24121860     DOI: 10.1039/c3cp53545b

Source DB:  PubMed          Journal:  Phys Chem Chem Phys        ISSN: 1463-9076            Impact factor:   3.676


  35 in total

1.  DNA RECOMBINATION. Base triplet stepping by the Rad51/RecA family of recombinases.

Authors:  Ja Yil Lee; Tsuyoshi Terakawa; Zhi Qi; Justin B Steinfeld; Sy Redding; YoungHo Kwon; William A Gaines; Weixing Zhao; Patrick Sung; Eric C Greene
Journal:  Science       Date:  2015-08-28       Impact factor: 47.728

2.  Electron transfer characteristics of 2'-deoxy-2'-fluoro-arabinonucleic acid, a nucleic acid with enhanced chemical stability.

Authors:  Ruijie D Teo; Kiriko Terai; Agostino Migliore; David N Beratan
Journal:  Phys Chem Chem Phys       Date:  2018-09-07       Impact factor: 3.676

Review 3.  Close encounters with DNA.

Authors:  C Maffeo; J Yoo; J Comer; D B Wells; B Luan; A Aksimentiev
Journal:  J Phys Condens Matter       Date:  2014-09-19       Impact factor: 2.333

4.  Structure and conformational dynamics of scaffolded DNA origami nanoparticles.

Authors:  Keyao Pan; William P Bricker; Sakul Ratanalert; Mark Bathe
Journal:  Nucleic Acids Res       Date:  2017-06-20       Impact factor: 16.971

5.  DNA bipedal motor walking dynamics: an experimental and theoretical study of the dependency on step size.

Authors:  Dinesh C Khara; John S Schreck; Toma E Tomov; Yaron Berger; Thomas E Ouldridge; Jonathan P K Doye; Eyal Nir
Journal:  Nucleic Acids Res       Date:  2018-02-16       Impact factor: 16.971

6.  The temperature dependence of the helical twist of DNA.

Authors:  Franziska Kriegel; Christian Matek; Tomáš Dršata; Klara Kulenkampff; Sophie Tschirpke; Martin Zacharias; Filip Lankaš; Jan Lipfert
Journal:  Nucleic Acids Res       Date:  2018-09-06       Impact factor: 16.971

7.  A coarse-grained model for assisting the investigation of structure and dynamics of large nucleic acids by ion mobility spectrometry-mass spectrometry.

Authors:  S Vangaveti; R J D'Esposito; J L Lippens; D Fabris; S V Ranganathan
Journal:  Phys Chem Chem Phys       Date:  2017-06-14       Impact factor: 3.676

8.  Long-range correlations in the mechanics of small DNA circles under topological stress revealed by multi-scale simulation.

Authors:  Thana Sutthibutpong; Christian Matek; Craig Benham; Gabriel G Slade; Agnes Noy; Charles Laughton; Jonathan P K Doye; Ard A Louis; Sarah A Harris
Journal:  Nucleic Acids Res       Date:  2016-09-22       Impact factor: 16.971

9.  DNA hairpins destabilize duplexes primarily by promoting melting rather than by inhibiting hybridization.

Authors:  John S Schreck; Thomas E Ouldridge; Flavio Romano; Petr Šulc; Liam P Shaw; Ard A Louis; Jonathan P K Doye
Journal:  Nucleic Acids Res       Date:  2015-06-08       Impact factor: 16.971

10.  A strand graph semantics for DNA-based computation.

Authors:  Rasmus L Petersen; Matthew R Lakin; Andrew Phillips
Journal:  Theor Comput Sci       Date:  2016-06-13       Impact factor: 0.827

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